SpectraBase Compound ID | 1wAPwXLCTeO |
---|---|
InChI | InChI=1S/C11H14O2/c1-8-3-9(2)5-10(4-8)12-6-11-7-13-11/h3-5,11H,6-7H2,1-2H3 |
InChIKey | ALJXKSOYHMOQSF-UHFFFAOYSA-N |
Mol Weight | 178.23 g/mol |
Molecular Formula | C11H14O2 |
Exact Mass | 178.09938 g/mol |
SpectraBase Spectrum ID | BT6Bl0HsSw5 |
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Name | 2,3-Epoxypropyl 3,5-xylyl ether |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 178.099379689 u |
Formula | C11H14O2 |
InChI | InChI=1S/C11H14O2/c1-8-3-9(2)5-10(4-8)12-6-11-7-13-11/h3-5,11H,6-7H2,1-2H3 |
InChIKey | ALJXKSOYHMOQSF-UHFFFAOYSA-N |
Molecular Weight | 178.231 g/mol |
SMILES | C1(=CC(=CC(=C1)OCC1CO1)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.889517 |